Vitas-M small molecule compound
N~2~-(1H-benzotriazol-1-ylacetyl)-N-[4-(morpholin-4-yl)phenyl]-N~2~-(pyridin-3-ylmethyl)isovalinamide
Catalog ID
STL437539
SMILES CCC(N(C(=O)Cn1nnc2c1cccc2)Cc1cccnc1)(C(=O)Nc1ccc(cc1)N1CCOCC1)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C29H33N7O3 MW 527.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N7O3/c1-3-29(2,28(38)31-23-10-12-24(13-11-23)34-15-17-39-18-16-34)35(20-22-7-6-14-30-19-22)27(37)21-36-26-9-5-4-8-25(26)32-33-36/h4-14,19H,3,15-18,20-21H2,1-2H3,(H,31,38)InChIKey
LCIOJDBDQQSDFE-UHFFFAOYSA-NSynonyms
2((2(BENZOTRIAZOL1YL)ACETYL)(PYRIDIN3YLMETHYL)AMINO)2METHYLN(4MORPHOLIN4YLPHENYL)BUTANAMIDE
2(2(1HBENZO(D)(123)TRIAZOL1YL)N(PYRIDIN3YLMETHYL)ACETAMIDO)2METHYLN(4MORPHOLINOPHENYL)BUTANAMIDE
CCC(C)(C(=O)NC1=CC=C(C=C1)N2CCOCC2)N(CC3=CN=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4
InChI=1SC29H33N7O3c1329(228(38)3123101224(131123)34151739181634)35(20227614301922)27(37)213626954825(26)323336h41419H315182021H212H3(H3138)
MFCD06244488
N~2~(1Hbenzotriazol1ylacetyl)N(4(morpholin4yl)phenyl)N~2~(pyridin3ylmethyl)isovalinamide
ZINC000008694429
ZINC000008694430
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